![(2Z)-3-Methyl-3-[(2-phenylethyl)carbamoyl]prop-2-enoic acid structure](/static/products/683/683248-17-1.png)
(2Z)-3-Methyl-3-[(2-phenylethyl)carbamoyl]prop-2-enoic acid
TL;DR: (2Z)-3-Methyl-3-[(2-phenylethyl)carbamoyl]prop-2-enoic acid (CAS 683248-17-1) is a chemical compound with molecular formula C13H15NO3 and molecular weight 233.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-methyl-4-oxo-4-(2-phenylethylamino)but-2-enoic acid
Also Known As: (E)-3-methyl-4-oxo-4-(phenethylamino)but-2-enoic acid, (2Z)-3-METHYL-3-[(2-PHENYLETHYL)CARBAMOYL]PROP-2-ENOIC ACID
| Molecular Formula | C13H15NO3 |
|---|---|
| Molecular Weight | 233.11 g/mol |
| LogP | 1.3762 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 233.1052 |
| Heavy Atoms | 17 |
| Complexity | 423.55054 |
Chemical Identifiers
| CAS Number | 683248-17-1 |
|---|---|
| SMILES | C/C(=C\C(=O)O)/C(=O)NCCC1=CC=CC=C1 |
Product Overview
(2Z)-3-Methyl-3-[(2-phenylethyl)carbamoyl]prop-2-enoic acid (CAS 683248-17-1), with molecular formula C13H15NO3 and molecular weight 233.11 g/mol. IUPAC: (E)-3-methyl-4-oxo-4-(2-phenylethylamino)but-2-enoic acid.
Chemical Property Profile of (2Z)-3-Methyl-3-[(2-phenylethyl)carbamoyl]prop-2-enoic acid
Property Insights of (2Z)-3-Methyl-3-[(2-phenylethyl)carbamoyl]prop-2-enoic acid
The XLogP value of 1.3762 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2Z)-3-Methyl-3-[(2-phenylethyl)carbamoyl]prop-2-enoic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for (2Z)-3-Methyl-3-[(2-phenylethyl)carbamoyl]prop-2-enoic acid. Following Lipinski's Rule of Five, (2Z)-3-Methyl-3-[(2-phenylethyl)carbamoyl]prop-2-enoic acid has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (2Z)-3-Methyl-3-[(2-phenylethyl)carbamoyl]prop-2-enoic acid?
The CAS number of (2Z)-3-Methyl-3-[(2-phenylethyl)carbamoyl]prop-2-enoic acid is 683248-17-1.
What is the molecular formula of (2Z)-3-Methyl-3-[(2-phenylethyl)carbamoyl]prop-2-enoic acid?
The molecular formula of (2Z)-3-Methyl-3-[(2-phenylethyl)carbamoyl]prop-2-enoic acid is C13H15NO3.
What is the molecular weight of (2Z)-3-Methyl-3-[(2-phenylethyl)carbamoyl]prop-2-enoic acid?
The molecular weight of (2Z)-3-Methyl-3-[(2-phenylethyl)carbamoyl]prop-2-enoic acid is 233.11 g/mol.
Where can I buy (2Z)-3-Methyl-3-[(2-phenylethyl)carbamoyl]prop-2-enoic acid?
You can request a quote for (2Z)-3-Methyl-3-[(2-phenylethyl)carbamoyl]prop-2-enoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2Z)-3-Methyl-3-[(2-phenylethyl)carbamoyl]prop-2-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for (2Z)-3-Methyl-3-[(2-phenylethyl)carbamoyl]prop-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.